1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene

C14H9F3 — CID 134146382

IUPAC1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene
SMILESFc1ccc(F)c(/C=C/c2ccccc2F)c1
InChIInChI=1S/C14H9F3/c15-12-7-8-14(17)11(9-12)6-5-10-3-1-2-4-13(10)16/h1-9H/b6-5+
InChIKeyYTGZKFWCFSGGEM-AATRIKPKSA-N
MW234.22 g/mol
LogP4.27
Rot. Bonds2

About 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene

1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene (PubChem CID 134146382) has the molecular formula C14H9F3 and a molecular weight of 234.22 g/mol. Its IUPAC name is 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene.

Molecular Properties

Compound Name1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene
PubChem CID134146382
Molecular FormulaC14H9F3
Molecular Weight234.22 g/mol
Exact Mass234.07
IUPAC Name1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene
SMILESFc1ccc(F)c(/C=C/c2ccccc2F)c1
InChIInChI=1S/C14H9F3/c15-12-7-8-14(17)11(9-12)6-5-10-3-1-2-4-13(10)16/h1-9H/b6-5+
InChIKeyYTGZKFWCFSGGEM-AATRIKPKSA-N
XLogP4.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene?
The IUPAC name of 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene (CID 134146382) is 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene.
What is the SMILES notation for 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene?
The canonical SMILES for 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene is Fc1ccc(F)c(/C=C/c2ccccc2F)c1.
What is the InChIKey of 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene?
The InChIKey is YTGZKFWCFSGGEM-AATRIKPKSA-N. The full InChI is InChI=1S/C14H9F3/c15-12-7-8-14(17)11(9-12)6-5-10-3-1-2-4-13(10)16/h1-9H/b6-5+.
What are the key properties of 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene?
1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene has a molecular weight of 234.22 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene is sourced from PubChem (CID 134146382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).